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1-hydroxy-4-unsubstituted benzenoids

Aromatic organic compounds that contain a hydroxyl functional group (R-OH, where each R is a benzene ring) with no substituents in the fourth carbon, or the fourth position, in the benzene ring.
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1

TraceCERT™ Guaiacol, 2000 μg/mL, Certified Reference Material, MilliporeSigma™ Supelco™

This certified reference material (CRM) is produced and certified in accordance with ISO/IEC 17025 and ISO 17034. This CRM is traceable to the SI through a primary reference material from a NMI. Certified content incl. uncertainty and expiry date are stated on the enclosed certificate.

2

2-Ethoxyphenol, 98%, Thermo Scientific Chemicals

CAS: 94-71-3 Formule moléculaire: C8H10O2 Poids moléculaire (g/mol): 138.17 Numéro MDL: MFCD00002187 Clé InChI: MOEFFSWKSMRFRQ-UHFFFAOYSA-N Synonyme: o-ethoxyphenol,phenol, 2-ethoxy,guaethol,guethol,2-ethyloxyphenol,guaiethol,pyrocatechol monoethyl ether,catechol monoethyl ether,phenol, o-ethoxy,unii-878iw8p9pw CID PubChem: 66755 Nom IUPAC: 2-ethoxyphenol SMILES: CCOC1=CC=CC=C1O

Poids moléculaire (g/mol) 138.17
Synonyme o-ethoxyphenol,phenol, 2-ethoxy,guaethol,guethol,2-ethyloxyphenol,guaiethol,pyrocatechol monoethyl ether,catechol monoethyl ether,phenol, o-ethoxy,unii-878iw8p9pw
Numéro MDL MFCD00002187
CAS 94-71-3
CID PubChem 66755
Nom IUPAC 2-ethoxyphenol
Clé InChI MOEFFSWKSMRFRQ-UHFFFAOYSA-N
SMILES CCOC1=CC=CC=C1O
Formule moléculaire C8H10O2
3

2-Phenylphenol, 99%

CAS: 90-43-7 Formule moléculaire: C12H10O Poids moléculaire (g/mol): 170.21 Numéro MDL: MFCD00002208 Clé InChI: LLEMOWNGBBNAJR-UHFFFAOYSA-N Synonyme: 2-hydroxybiphenyl,o-phenylphenol,biphenyl-2-ol,2-biphenylol,o-hydroxybiphenyl,2-hydroxydiphenyl,o-hydroxydiphenyl,phenylphenol,biphenylol,1,1'-biphenyl-2-ol CID PubChem: 7017 ChEBI: CHEBI:17043 SMILES: OC1=CC=CC=C1C1=CC=CC=C1

Poids moléculaire (g/mol) 170.21
Synonyme 2-hydroxybiphenyl,o-phenylphenol,biphenyl-2-ol,2-biphenylol,o-hydroxybiphenyl,2-hydroxydiphenyl,o-hydroxydiphenyl,phenylphenol,biphenylol,1,1'-biphenyl-2-ol
Numéro MDL MFCD00002208
CAS 90-43-7
CID PubChem 7017
ChEBI CHEBI:17043
Clé InChI LLEMOWNGBBNAJR-UHFFFAOYSA-N
SMILES OC1=CC=CC=C1C1=CC=CC=C1
Formule moléculaire C12H10O
4

2-Hydroxyphenylacetic acid, 98%

CAS: 614-75-5 Formule moléculaire: C8H8O3 Poids moléculaire (g/mol): 152.149 Numéro MDL: MFCD00004323 Clé InChI: CCVYRRGZDBSHFU-UHFFFAOYSA-N Synonyme: 2-hydroxyphenylacetic acid,2-2-hydroxyphenyl acetic acid,2-hydroxyphenyl acetic acid,benzeneacetic acid, 2-hydroxy,2-hydroxybenzeneacetic acid,o-hydroxyphenylacetic acid,acetic acid, o-hydroxyphenyl,2-hydroxyphenylacetate,o-hydroxyphenyl acetic acid,ortho-hydroxyphenylacetic acid CID PubChem: 11970 ChEBI: CHEBI:28478 Nom IUPAC: 2-(2-hydroxyphenyl)acetic acid SMILES: C1=CC=C(C(=C1)CC(=O)O)O

Poids moléculaire (g/mol) 152.149
Synonyme 2-hydroxyphenylacetic acid,2-2-hydroxyphenyl acetic acid,2-hydroxyphenyl acetic acid,benzeneacetic acid, 2-hydroxy,2-hydroxybenzeneacetic acid,o-hydroxyphenylacetic acid,acetic acid, o-hydroxyphenyl,2-hydroxyphenylacetate,o-hydroxyphenyl acetic acid,ortho-hydroxyphenylacetic acid
Numéro MDL MFCD00004323
CAS 614-75-5
CID PubChem 11970
ChEBI CHEBI:28478
Nom IUPAC 2-(2-hydroxyphenyl)acetic acid
Clé InChI CCVYRRGZDBSHFU-UHFFFAOYSA-N
SMILES C1=CC=C(C(=C1)CC(=O)O)O
Formule moléculaire C8H8O3
5

Calix[8]arene, 97%

CAS: 82452-93-5 Formule moléculaire: C56H48O8 Poids moléculaire (g/mol): 848.992 Numéro MDL: MFCD00143914 Clé InChI: HDPRHRZFFPXZIL-UHFFFAOYSA-N Synonyme: calix 8 arene,calix 8 arene;,p-h-calix 8 arene,octahydroxycalix 8 arene,para-h-calix 8 arene;,calix 8 arene, technical ch,49,50,51,52,53,54,55,56-octahydroxycalix 8 arene,49,50,51,52,53,54,55,56-octahydroxycalix 8 arene;,49,50,51,52,53,54,55,56-octahydroxycalix 8-arene;,49,50,51,52,53,54,55,56-octakis hydroxy calix 8 arene; CID PubChem: 2724886 SMILES: C1C2=C(C(=CC=C2)CC3=C(C(=CC=C3)CC4=C(C(=CC=C4)CC5=C(C(=CC=C5)CC6=CC=CC(=C6O)CC7=CC=CC(=C7O)CC8=CC=CC(=C8O)CC9=CC=CC1=C9O)O)O)O)O

Poids moléculaire (g/mol) 848.992
Synonyme calix 8 arene,calix 8 arene;,p-h-calix 8 arene,octahydroxycalix 8 arene,para-h-calix 8 arene;,calix 8 arene, technical ch,49,50,51,52,53,54,55,56-octahydroxycalix 8 arene,49,50,51,52,53,54,55,56-octahydroxycalix 8 arene;,49,50,51,52,53,54,55,56-octahydroxycalix 8-arene;,49,50,51,52,53,54,55,56-octakis hydroxy calix 8 arene;
Numéro MDL MFCD00143914
CAS 82452-93-5
CID PubChem 2724886
Clé InChI HDPRHRZFFPXZIL-UHFFFAOYSA-N
SMILES C1C2=C(C(=CC=C2)CC3=C(C(=CC=C3)CC4=C(C(=CC=C4)CC5=C(C(=CC=C5)CC6=CC=CC(=C6O)CC7=CC=CC(=C7O)CC8=CC=CC(=C8O)CC9=CC=CC1=C9O)O)O)O)O
Formule moléculaire C56H48O8
6

2-Allylphenol, 98+%

CAS: 1745-81-9 Formule moléculaire: C9H10O Poids moléculaire (g/mol): 134.178 Numéro MDL: MFCD00002250 Clé InChI: QIRNGVVZBINFMX-UHFFFAOYSA-N Synonyme: 2-allylphenol,o-allylphenol,phenol, o-allyl,phenol, 2-2-propenyl,phenol, 2-propenyl,2-prop-2-en-1-yl phenol,2-2-propenyl phenol,2-allyl-phenol,unii-o04f145zjz,2-prop-2-en-1-ylphenol CID PubChem: 15624 ChEBI: CHEBI:39826 Nom IUPAC: 2-prop-2-enylphenol SMILES: C=CCC1=CC=CC=C1O

Poids moléculaire (g/mol) 134.178
Synonyme 2-allylphenol,o-allylphenol,phenol, o-allyl,phenol, 2-2-propenyl,phenol, 2-propenyl,2-prop-2-en-1-yl phenol,2-2-propenyl phenol,2-allyl-phenol,unii-o04f145zjz,2-prop-2-en-1-ylphenol
Numéro MDL MFCD00002250
CAS 1745-81-9
CID PubChem 15624
ChEBI CHEBI:39826
Nom IUPAC 2-prop-2-enylphenol
Clé InChI QIRNGVVZBINFMX-UHFFFAOYSA-N
SMILES C=CCC1=CC=CC=C1O
Formule moléculaire C9H10O
7

Salicylamide, 99%

CAS: 65-45-2 Formule moléculaire: C7H7NO2 Poids moléculaire (g/mol): 137.14 Numéro MDL: MFCD00007978 Clé InChI: SKZKKFZAGNVIMN-UHFFFAOYSA-N Synonyme: salicylamide,o-hydroxybenzamide,benzamide, 2-hydroxy,salicylic acid amide,2-carbamoylphenol,flarpirina,morsarinas,algamon,algiamida,allevin CID PubChem: 5147 ChEBI: CHEBI:32114 Nom IUPAC: 2-hydroxybenzamide SMILES: NC(=O)C1=CC=CC=C1O

Poids moléculaire (g/mol) 137.14
Synonyme salicylamide,o-hydroxybenzamide,benzamide, 2-hydroxy,salicylic acid amide,2-carbamoylphenol,flarpirina,morsarinas,algamon,algiamida,allevin
Numéro MDL MFCD00007978
CAS 65-45-2
CID PubChem 5147
ChEBI CHEBI:32114
Nom IUPAC 2-hydroxybenzamide
Clé InChI SKZKKFZAGNVIMN-UHFFFAOYSA-N
SMILES NC(=O)C1=CC=CC=C1O
Formule moléculaire C7H7NO2
8

Dobutamine hydrochloride

CAS: 49745-95-1 Formule moléculaire: C18H24ClNO3 Poids moléculaire (g/mol): 337.84 Numéro MDL: MFCD00153795 Clé InChI: BQKADKWNRWCIJL-UHFFFAOYNA-N Synonyme: dobutamine hydrochloride,dobutamine hcl,dobutrex,inotrex,dl-dobutamine hydrochloride,dobutamina clorhidrato spanish,4-2-4-4-hydroxyphenyl butan-2-ylamino ethyl benzene-1,2-diol hydrochloride,+--4-2-3-p-hydroxyphenyl-1-methylpropyl amino ethyl pyrocatechol hydrochloride,1,2-benzenediol, 4-2-3-4-hydroxyphenyl-1-methylpropyl amino ethyl-, hydrochloride, +- CID PubChem: 65324 ChEBI: CHEBI:4671 Nom IUPAC: hydrogen 4-(2-{[4-(4-hydroxyphenyl)butan-2-yl]amino}ethyl)benzene-1,2-diol chloride SMILES: [H+].[Cl-].CC(CCC1=CC=C(O)C=C1)NCCC1=CC=C(O)C(O)=C1

Poids moléculaire (g/mol) 337.84
Synonyme dobutamine hydrochloride,dobutamine hcl,dobutrex,inotrex,dl-dobutamine hydrochloride,dobutamina clorhidrato spanish,4-2-4-4-hydroxyphenyl butan-2-ylamino ethyl benzene-1,2-diol hydrochloride,+--4-2-3-p-hydroxyphenyl-1-methylpropyl amino ethyl pyrocatechol hydrochloride,1,2-benzenediol, 4-2-3-4-hydroxyphenyl-1-methylpropyl amino ethyl-, hydrochloride, +-
Numéro MDL MFCD00153795
CAS 49745-95-1
CID PubChem 65324
ChEBI CHEBI:4671
Nom IUPAC hydrogen 4-(2-{[4-(4-hydroxyphenyl)butan-2-yl]amino}ethyl)benzene-1,2-diol chloride
Clé InChI BQKADKWNRWCIJL-UHFFFAOYNA-N
SMILES [H+].[Cl-].CC(CCC1=CC=C(O)C=C1)NCCC1=CC=C(O)C(O)=C1
Formule moléculaire C18H24ClNO3
9

Calix[4]arene, 98%

CAS: 74568-07-3 Formule moléculaire: C28H24O4 Poids moléculaire (g/mol): 424.496 Numéro MDL: MFCD00143912 Clé InChI: YPNHVQZZPXPQOS-UHFFFAOYSA-N Synonyme: calix 4 arene,tetrahydroxycalix 4 arene,calix 4 arene 1g,calix 4 arene-25,26,27,28-tetrol,25,26,27,28-tetrahydroxycalix 4 aren,25,26,27,28-tetrahydroxycalix 4 arene,calix 4 arene-25,26,27,28-tetrol, purum hplc CID PubChem: 562409 SMILES: C1C2=C(C(=CC=C2)CC3=C(C(=CC=C3)CC4=CC=CC(=C4O)CC5=CC=CC1=C5O)O)O

Poids moléculaire (g/mol) 424.496
Synonyme calix 4 arene,tetrahydroxycalix 4 arene,calix 4 arene 1g,calix 4 arene-25,26,27,28-tetrol,25,26,27,28-tetrahydroxycalix 4 aren,25,26,27,28-tetrahydroxycalix 4 arene,calix 4 arene-25,26,27,28-tetrol, purum hplc
Numéro MDL MFCD00143912
CAS 74568-07-3
CID PubChem 562409
Clé InChI YPNHVQZZPXPQOS-UHFFFAOYSA-N
SMILES C1C2=C(C(=CC=C2)CC3=C(C(=CC=C3)CC4=CC=CC(=C4O)CC5=CC=CC1=C5O)O)O
Formule moléculaire C28H24O4
10

3-Hydroxyphenylacetic acid, 99%

CAS: 621-37-4 Formule moléculaire: C8H8O3 Poids moléculaire (g/mol): 152.15 Numéro MDL: MFCD00004337 Clé InChI: FVMDYYGIDFPZAX-UHFFFAOYSA-N Synonyme: 3-hydroxyphenylacetic acid,2-3-hydroxyphenyl acetic acid,3-hydroxyphenyl acetic acid,3-hydroxybenzeneacetic acid,3-hydroxyphenylacetate,m-hydroxyphenylacetic acid,m-hydroxyphenyl acetic acid,benzeneacetic acid, 3-hydroxy,metahydroxy phenylacetic acid,acetic acid, m-hydroxyphenyl CID PubChem: 12122 ChEBI: CHEBI:17445 Nom IUPAC: 2-(3-hydroxyphenyl)acetic acid SMILES: OC(=O)CC1=CC=CC(O)=C1

Poids moléculaire (g/mol) 152.15
Synonyme 3-hydroxyphenylacetic acid,2-3-hydroxyphenyl acetic acid,3-hydroxyphenyl acetic acid,3-hydroxybenzeneacetic acid,3-hydroxyphenylacetate,m-hydroxyphenylacetic acid,m-hydroxyphenyl acetic acid,benzeneacetic acid, 3-hydroxy,metahydroxy phenylacetic acid,acetic acid, m-hydroxyphenyl
Numéro MDL MFCD00004337
CAS 621-37-4
CID PubChem 12122
ChEBI CHEBI:17445
Nom IUPAC 2-(3-hydroxyphenyl)acetic acid
Clé InChI FVMDYYGIDFPZAX-UHFFFAOYSA-N
SMILES OC(=O)CC1=CC=CC(O)=C1
Formule moléculaire C8H8O3
11

2,6-Dimethoxyphenol, 99%

CAS: 91-10-1 Formule moléculaire: C8H10O3 Poids moléculaire (g/mol): 154.17 Numéro MDL: MFCD00064434 Clé InChI: KLIDCXVFHGNTTM-UHFFFAOYSA-N Synonyme: syringol,pyrogallol 1,3-dimethyl ether,1,3-dimethyl pyrogallate,phenol, 2,6-dimethoxy,2-hydroxy-1,3-dimethoxybenzene,1,3-di-o-methylpyrogallol,1,3-dimethoxy-2-hydroxybenzene,2,6-dimethoxy-phenol,pyrogallol dimethylether,2,6-dwumetoksyfenol CID PubChem: 7041 ChEBI: CHEBI:955 Nom IUPAC: 2,6-dimethoxyphenol SMILES: COC1=CC=CC(OC)=C1O

Poids moléculaire (g/mol) 154.17
Synonyme syringol,pyrogallol 1,3-dimethyl ether,1,3-dimethyl pyrogallate,phenol, 2,6-dimethoxy,2-hydroxy-1,3-dimethoxybenzene,1,3-di-o-methylpyrogallol,1,3-dimethoxy-2-hydroxybenzene,2,6-dimethoxy-phenol,pyrogallol dimethylether,2,6-dwumetoksyfenol
Numéro MDL MFCD00064434
CAS 91-10-1
CID PubChem 7041
ChEBI CHEBI:955
Nom IUPAC 2,6-dimethoxyphenol
Clé InChI KLIDCXVFHGNTTM-UHFFFAOYSA-N
SMILES COC1=CC=CC(OC)=C1O
Formule moléculaire C8H10O3
12

2-Methoxyphenol, 98+%

CAS: 90-05-1 Formule moléculaire: C7H8O2 Poids moléculaire (g/mol): 124.139 Numéro MDL: MFCD00002185 Clé InChI: LHGVFZTZFXWLCP-UHFFFAOYSA-N Synonyme: guaiacol,o-methoxyphenol,2-hydroxyanisole,phenol, 2-methoxy,pyrocatechol monomethyl ether,methylcatechol,guaiastil,guaicol,1-hydroxy-2-methoxybenzene,pyroguaiac acid CID PubChem: 460 ChEBI: CHEBI:28591 Nom IUPAC: 2-methoxyphenol SMILES: COC1=CC=CC=C1O

Poids moléculaire (g/mol) 124.139
Synonyme guaiacol,o-methoxyphenol,2-hydroxyanisole,phenol, 2-methoxy,pyrocatechol monomethyl ether,methylcatechol,guaiastil,guaicol,1-hydroxy-2-methoxybenzene,pyroguaiac acid
Numéro MDL MFCD00002185
CAS 90-05-1
CID PubChem 460
ChEBI CHEBI:28591
Nom IUPAC 2-methoxyphenol
Clé InChI LHGVFZTZFXWLCP-UHFFFAOYSA-N
SMILES COC1=CC=CC=C1O
Formule moléculaire C7H8O2
13

3-Ethoxyphenol, 98%

CAS: 621-34-1 Formule moléculaire: C8H10O2 Poids moléculaire (g/mol): 138.166 Numéro MDL: MFCD00016450 Clé InChI: VBIKLMJHBGFTPV-UHFFFAOYSA-N Synonyme: m-ethoxyphenol,phenol, 3-ethoxy,phenol, m-ethoxy,resorcinol monoethyl ether,3-ethoxy-phenol,unii-iky4o3474a,3-ethyloxy phenol,pubchem9510,acmc-209mzu,phenol, m-ethoxy-8ci CID PubChem: 69306 Nom IUPAC: 3-ethoxyphenol SMILES: CCOC1=CC=CC(=C1)O

Poids moléculaire (g/mol) 138.166
Synonyme m-ethoxyphenol,phenol, 3-ethoxy,phenol, m-ethoxy,resorcinol monoethyl ether,3-ethoxy-phenol,unii-iky4o3474a,3-ethyloxy phenol,pubchem9510,acmc-209mzu,phenol, m-ethoxy-8ci
Numéro MDL MFCD00016450
CAS 621-34-1
CID PubChem 69306
Nom IUPAC 3-ethoxyphenol
Clé InChI VBIKLMJHBGFTPV-UHFFFAOYSA-N
SMILES CCOC1=CC=CC(=C1)O
Formule moléculaire C8H10O2
14

3-Hydroxy-5-(trifluoromethyl)benzoic acid, 99%, Thermo Scientific Chemicals

CAS: 328-69-8 Formule moléculaire: C8H5F3O3 Poids moléculaire (g/mol): 206.12 Numéro MDL: MFCD07368783 Clé InChI: BJUOAPFXYPEEMK-UHFFFAOYSA-N Synonyme: 3-hydroxy-5-trifluoromethyl benzoic acid,3-hydroxy-5-trifluoromethyl-benzoic acid,benzoic acid, 3-hydroxy-5-trifluoromethyl,3-hydroxy-5-trifluoromethylbenzoicacid,acmc-1cprz,ksc496i2d,3-carboxy-5-hydroxybenzotrifluoride,3-carboxy-5-trifluoromethyl phenol,5-hydroxy-3-trifluoromethyl-benzoic acid,5-hydroxy-3-trifluoromethyl benzoic acid CID PubChem: 2783146 Nom IUPAC: 3-hydroxy-5-(trifluoromethyl)benzoic acid SMILES: C1=C(C=C(C=C1C(F)(F)F)O)C(=O)O

Poids moléculaire (g/mol) 206.12
Synonyme 3-hydroxy-5-trifluoromethyl benzoic acid,3-hydroxy-5-trifluoromethyl-benzoic acid,benzoic acid, 3-hydroxy-5-trifluoromethyl,3-hydroxy-5-trifluoromethylbenzoicacid,acmc-1cprz,ksc496i2d,3-carboxy-5-hydroxybenzotrifluoride,3-carboxy-5-trifluoromethyl phenol,5-hydroxy-3-trifluoromethyl-benzoic acid,5-hydroxy-3-trifluoromethyl benzoic acid
Numéro MDL MFCD07368783
CAS 328-69-8
CID PubChem 2783146
Nom IUPAC 3-hydroxy-5-(trifluoromethyl)benzoic acid
Clé InChI BJUOAPFXYPEEMK-UHFFFAOYSA-N
SMILES C1=C(C=C(C=C1C(F)(F)F)O)C(=O)O
Formule moléculaire C8H5F3O3
15

Methyl 3-(2-hydroxyphenyl)propionate, 97%

CAS: 20349-89-7 Formule moléculaire: C10H12O3 Poids moléculaire (g/mol): 180.203 Numéro MDL: MFCD00067757 Clé InChI: YHXYRISRGHSPNV-UHFFFAOYSA-N Synonyme: methyl 3-2-hydroxyphenyl propanoate,methyl 3-2-hydroxyphenyl propionate,methyl melilotate,acmc-20aki4,methyl hydroxy-benzenepropionate,methyl 2'-hydroxyhydrocinnamate,methyl 3-hydroxyphenyl propionate,methyl 3 2-hydroxyphenyl propanoate,2-hydroxybenzenepropanoic acid methyl ester,3-2-hydroxyphenyl propionic acid methyl ester CID PubChem: 2794569 Nom IUPAC: methyl 3-(2-hydroxyphenyl)propanoate SMILES: COC(=O)CCC1=CC=CC=C1O

Poids moléculaire (g/mol) 180.203
Synonyme methyl 3-2-hydroxyphenyl propanoate,methyl 3-2-hydroxyphenyl propionate,methyl melilotate,acmc-20aki4,methyl hydroxy-benzenepropionate,methyl 2'-hydroxyhydrocinnamate,methyl 3-hydroxyphenyl propionate,methyl 3 2-hydroxyphenyl propanoate,2-hydroxybenzenepropanoic acid methyl ester,3-2-hydroxyphenyl propionic acid methyl ester
Numéro MDL MFCD00067757
CAS 20349-89-7
CID PubChem 2794569
Nom IUPAC methyl 3-(2-hydroxyphenyl)propanoate
Clé InChI YHXYRISRGHSPNV-UHFFFAOYSA-N
SMILES COC(=O)CCC1=CC=CC=C1O
Formule moléculaire C10H12O3